Structure Database (LMSD)

Common Name
Eicosan-1-ol
Systematic Name
Eicosan-1-ol
Synonyms
LM ID
LMFA05000221
Status
Active
Exact Mass
Calculate m/z
298.323565
Formula
Abbrev



Download as...
MDLMOL SDF CSV TSV
MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".

Main

Classification

Category
Main Class
Sub Class

String Representations

InChiKey (Click to copy)
BTFJIXJJCSYFAL-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C20H42O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21/h21H,2-20H2,1H3
SMILES (Click to copy)
OCCCCCCCCCCCCCCCCCCCC

References

Comments
Pherobase

Other Databases

HMDB ID
CHEBI ID
PubChem CID
SwissLipids ID

Calculated Physicochemical Properties

Heavy Atoms 21
Rings 0
Aromatic Rings 0
Rotatable Bonds 18
Van der Waals Molecular Volume 363.35
Topological Polar Surface Area 20.23
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 1
logP 7.31
Molar Refractivity 96.36

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Created at
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Updated at
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